SCHEMBL14036119

SCHEMBL14036119

Cc1ccc2cc(C(=O)c3ccccc3)ccc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.66
MEN1 O00255 1/20 0.66
NPC1 O15118 1/20 0.66
KMT2A Q03164 1/20 0.66
TDP1 Q9NUW8 2/20 0.55
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CYP2A6 P11509 2/20 0.55
CNR2 P34972 1/20 0.54
ALDH1A1 P00352 4/20 0.54
LMNA P02545 1/20 0.54
ACHE P22303 1/20 0.53
SRD5A2 P31213 2/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
CLK1 P49759 1/20 0.51
DYRK1A Q13627 1/20 0.51
DYRK1B Q9Y463 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9718973 0.88 MEN1 (0.81) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL15040985 0.87 ALDH1A1 (0.61) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL21230327 0.86 ALDH1A1 (0.73) RAB9AMEN1NPC1KMT2AATM
SCHEMBL14596910 0.85 ALDH1A1 (0.59) RAB9AMEN1NPC1KMT2ACYP2A6
SCHEMBL29834246 0.84 MEN1 (0.75) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL124894 0.84 MEN1 (0.75) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL15040984 0.84 KMT2A (0.60) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL12405825 0.82 MEN1 (0.72) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL235 0.82 ALDH1A1 (0.80) RAB9AMEN1NPC1KMT2ATDP1
SCHEMBL259065 0.82 ALDH1A1 (0.80) RAB9AMEN1NPC1KMT2ATDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3133444-A1 CHEMICALLY AMPLIFIED RESIST MATERIAL, PATTERN-FORMING METHOD, COMPOUND, AND PRODUCTION METHOD OF COMPOUND OSAKA UNIVERSITY (JP) 2017-02-22 EP disclosed
US-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed